1-[(2-heptadecyl-2-methyl-1,3-dioxolan-4-yl)methoxy]-5-pyridin-1-ium-1-yl-pentan-2-one

Systemtic Name: 1-[(2-heptadecyl-2-methyl-1,3-dioxolan-4-yl)methoxy]-5-pyridin-1-ium-1-yl-pentan-2-one Openeye Name: 1-[(2-heptadecyl-2-methyl-1,3-dioxolan-4-yl)methoxy]-5-pyridin-1-ium-1-yl-pentan-2-one CAS Name: 1-[(2-heptadecyl-2-methyl-1,3-dioxolan-4-yl)methoxy]-5-(1-pyridin-1-iumyl)-2-pentanone IUPAC Name: 1-[(2-heptadecyl-2-methyl-1,3-dioxolan-4-yl)methoxy]-5-pyridin-1-ium-1-ylpentan-2-one Traditional Name: 1-[(2-heptadecyl-2-methyl-1,3-dioxolan-4-yl)methoxy]-5-pyridin-1-ium-1-yl-pentan-2-one Formula: C32H56NO4+ MolecularWeight: 518.79134

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC1(OCC(O1)COCC(=O)CCC[N+]2=CC=CC=C2)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCC1(OCC(O1)COCC(=O)CCC[N+]2=CC=CC=C2)C

InChI

InChI=1S/C32H56NO4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-18-23-32(2)36-29-31(37-32)28-35-27-30(34)22-21-26-33-24-19-17-20-25-33/h17,19-20,24-25,31H,3-16,18,21-23,26-29H2,1-2H3/q+1